CID 457448

Glycine, n-2-naphthalenyl-

Structural Information

Molecular Formula
C12H11NO2
SMILES
C1=CC=C2C=C(C=CC2=C1)NCC(=O)O
InChI
InChI=1S/C12H11NO2/c14-12(15)8-13-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,13H,8H2,(H,14,15)
InChIKey
SEABHMYCRYLVKD-UHFFFAOYSA-N
Compound name
2-(naphthalen-2-ylamino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

106
Patents

201.07898 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.08626 140.9
[M+Na]+ 224.06820 148.0
[M-H]- 200.07170 144.2
[M+NH4]+ 219.11280 160.0
[M+K]+ 240.04214 144.6
[M+H-H2O]+ 184.07624 134.7
[M+HCOO]- 246.07718 163.6
[M+CH3COO]- 260.09283 185.3
[M+Na-2H]- 222.05365 148.9
[M]+ 201.07843 140.0
[M]- 201.07953 140.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.