CID 213201

25708-10-5

Structural Information

Molecular Formula
C12H19NO
SMILES
CN(C)CC(CC#CC1=CCCC1)O
InChI
InChI=1S/C12H19NO/c1-13(2)10-12(14)9-5-8-11-6-3-4-7-11/h6,12,14H,3-4,7,9-10H2,1-2H3
InChIKey
VIMUGQXFLHZFRX-UHFFFAOYSA-N
Compound name
5-(cyclopenten-1-yl)-1-(dimethylamino)pent-4-yn-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.14667 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.15395 147.2
[M+Na]+ 216.13589 155.5
[M+NH4]+ 211.18049 151.5
[M+K]+ 232.10983 148.6
[M-H]- 192.13939 140.4
[M+Na-2H]- 214.12134 148.1
[M]+ 193.14612 145.4
[M]- 193.14722 145.4
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.