CID 18596607

(2e)-5-amino-2-methylpent-2-enoic acid hydrochloride

Structural Information

Molecular Formula
C6H11NO2
SMILES
C/C(=C\CCN)/C(=O)O
InChI
InChI=1S/C6H11NO2/c1-5(6(8)9)3-2-4-7/h3H,2,4,7H2,1H3,(H,8,9)/b5-3+
InChIKey
UUZBMBGPWXYEQZ-HWKANZROSA-N
Compound name
(E)-5-amino-2-methylpent-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

955
Patents

129.07898 Da
Monoisotopic Mass

-2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.08626 128.5
[M+Na]+ 152.06820 134.6
[M-H]- 128.07170 126.9
[M+NH4]+ 147.11280 149.2
[M+K]+ 168.04214 133.6
[M+H-H2O]+ 112.07624 123.8
[M+HCOO]- 174.07718 150.0
[M+CH3COO]- 188.09283 171.8
[M+Na-2H]- 150.05365 131.5
[M]+ 129.07843 126.0
[M]- 129.07953 126.0
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

patents stripe