CID 134542807

(2s)-2-aminohex-5-en-3-ol hydrochloride

Structural Information

Molecular Formula
C6H13NO
SMILES
C[C@@H](C(CC=C)O)N
InChI
InChI=1S/C6H13NO/c1-3-4-6(8)5(2)7/h3,5-6,8H,1,4,7H2,2H3/t5-,6?/m0/s1
InChIKey
QFTLKTHCPBVHIC-ZBHICJROSA-N
Compound name
(2S)-2-aminohex-5-en-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

115.09972 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.10700 125.8
[M+Na]+ 138.08894 134.1
[M+NH4]+ 133.13354 133.0
[M+K]+ 154.06288 130.1
[M-H]- 114.09244 124.7
[M+Na-2H]- 136.07439 128.2
[M]+ 115.09917 126.2
[M]- 115.10027 126.2
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