Related entries (identical compound): PR100111 KNA00152 KNA00151 PR100534 KNA00560 KO002520 KNA00394 KNA00393 MT000092 KO002521 KNA00395 KNA00392 KNA00149 KNA00772 KNA00773 KNA00774 KNA00775 KNA00561 KNA00559 KO002518 KO002519 KO002517

Submission id: KNA00394

Outputs for Creatine; LC-ESI-ITFT; MS2; m/z:133.08; POS

Database: Graduate School of Information Science, NAIST
Entry ID: KNA00394
Synonyms: Creatine, alpha-Methylguanidino acetic acid, Methylglycocyamine
Total mass: 131.1328
Formula: H9 C4 O2 N3

Structure file (with ALATIS unique atom labels)

Experimental information

MS type: MS2
Instrument: LTQ Orbitrap XL, Thermo Scientfic
Instrument type: LC-ESI-ITFT
Ionization: ESI
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks:
Replicated queried mass peaks: 86.882813, 90.973907, 114.982712, 116.054504,
Processing time: 0:00:00.715286
Queried mass list: ['86.026', '89.972', '114.050']

Queried mass	Num. matched formulas	Num. matched fragments
86.026489 (link to fragments)	2	2
89.972397 (link to fragments)	1	1
114.049973 (link to fragments)	3	5