CID 145915781

2303752-03-4

Structural Information

Molecular Formula
C11H19NO
SMILES
CCCC1(CCN(C1)CCC#C)O
InChI
InChI=1S/C11H19NO/c1-3-5-8-12-9-7-11(13,10-12)6-4-2/h1,13H,4-10H2,2H3
InChIKey
GYMHGXDYEDTTQN-UHFFFAOYSA-N
Compound name
1-but-3-ynyl-3-propylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.14667 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.15395 140.1
[M+Na]+ 204.13589 149.0
[M-H]- 180.13939 139.4
[M+NH4]+ 199.18049 159.6
[M+K]+ 220.10983 144.5
[M+H-H2O]+ 164.14393 128.7
[M+HCOO]- 226.14487 154.2
[M+CH3COO]- 240.16052 187.6
[M+Na-2H]- 202.12134 142.7
[M]+ 181.14612 133.6
[M]- 181.14722 133.6
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.