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

literature stripe

Patent stripe

patents stripe