CID 495657

Nsc665638

Structural Information

Molecular Formula
C19H26GeO4
SMILES
CC[Ge](CC)(CC)C#CCOC(=O)C(C1=CC=CC=C1)OC(=O)C
InChI
InChI=1S/C19H26GeO4/c1-5-20(6-2,7-3)14-11-15-23-19(22)18(24-16(4)21)17-12-9-8-10-13-17/h8-10,12-13,18H,5-7,15H2,1-4H3
InChIKey
KYQBZPPXXCJSNA-UHFFFAOYSA-N
Compound name
3-triethylgermylprop-2-ynyl 2-acetyloxy-2-phenylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

392.10428 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 393.11156 194.6
[M+Na]+ 415.09350 200.2
[M-H]- 391.09700 195.0
[M+NH4]+ 410.13810 206.1
[M+K]+ 431.06744 196.3
[M+H-H2O]+ 375.10154 181.0
[M+HCOO]- 437.10248 206.5
[M+CH3COO]- 451.11813 216.2
[M+Na-2H]- 413.07895 192.2
[M]+ 392.10373 193.4
[M]- 392.10483 193.4
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.