CID 65940647

1496189-92-4

Structural Information

Molecular Formula
C10H17NO
SMILES
CC(C)C1(CN(C1)CCC#C)O
InChI
InChI=1S/C10H17NO/c1-4-5-6-11-7-10(12,8-11)9(2)3/h1,9,12H,5-8H2,2-3H3
InChIKey
NUIWQHDYCIIOEW-UHFFFAOYSA-N
Compound name
1-but-3-ynyl-3-propan-2-ylazetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.13101 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.13829 134.3
[M+Na]+ 190.12023 141.7
[M-H]- 166.12373 134.4
[M+NH4]+ 185.16483 147.1
[M+K]+ 206.09417 142.9
[M+H-H2O]+ 150.12827 119.7
[M+HCOO]- 212.12921 146.9
[M+CH3COO]- 226.14486 190.4
[M+Na-2H]- 188.10568 137.6
[M]+ 167.13046 136.4
[M]- 167.13156 136.4
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.